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PMID: 20017496 Published · ppublish English Evaluation Study Journal Article Research Support, N.I.H., Extramural Research Support, N.I.H., Intramural Research Support, Non-U.S. Gov't

Evaluation of substituted N,N'-diarylsulfonamides as activators of the tumor cell specific M2 isoform of pyruvate kinase.

Journal of medicinal chemistry ·Vol. 53 ·No. 3 ·2010-02-11 ·Pages 1048-55

Boxer MB, Jiang JK, Vander Heiden MG, Shen M, Skoumbourdis AP, Southall N, Veith H, Leister W, Austin CP, Park HW, Inglese J, Cantley LC, Auld DS, Thomas CJ

Abstract

The metabolism of cancer cells is altered to support rapid proliferation. Pharmacological activators of a tumor cell specific pyruvate kinase isozyme (PKM2) may be an approach for altering the classic Warburg effect characteristic of aberrant metabolism in cancer cells yielding a novel antiproliferation strategy. In this manuscript, we detail the discovery of a series of substituted N,N'-diarylsulfonamides as activators of PKM2. The synthesis of numerous analogues and the evaluation of structure-activity relationships are presented as well as assessments of mechanism and selectivity. Several agents are found that have good potencies and appropriate solubility for use as chemical probes of PKM2 including 55 (AC(50) = 43 nM, maximum response = 84%; solubility = 7.3 microg/mL), 56 (AC(50) = 99 nM, maximum response = 84%; solubility = 5.7 microg/mL), and 58 (AC(50) = 38 nM, maximum response = 82%; solubility = 51.2 microg/mL). The small molecules described here represent first-in-class activators of PKM2.

MeSH Terms
Binding Sites Enzyme Activation/drug effects Enzyme Inhibitors/pharmacology Humans L-Lactate Dehydrogenase/metabolism Luciferases/metabolism Molecular Structure Pyruvate Kinase/metabolism Small Molecule Libraries Structure-Activity Relationship Sulfonamides/chemical synthesis,chemistry,pharmacology
Chemicals
Enzyme Inhibitors Small Molecule Libraries Sulfonamides L-Lactate Dehydrogenase Luciferases Pyruvate Kinase
Authors & Affiliations
14 authors, click to expand affiliations / ORCID
Boxer Matthew B
NIH Chemical Genomics Center, National Human Genome Research Institute, National Institutes of Health, 9800 Medical Center Drive, MSC 3370 Bethesda, Maryland 20850, USA.
Jiang Jian-kang
Vander Heiden Matthew G
Shen Min
Skoumbourdis Amanda P
Southall Noel
Veith Henrike
Leister William
Austin Christopher P
Park Hee Won
Inglese James
Cantley Lewis C
Auld Douglas S
Thomas Craig J
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Article Info
Journal
Journal of medicinal chemistry
Abbr.
J Med Chem
ISSN
1520-4804
Published
2010-02-11
Pages
1048-55
Language
English
Region
United States
NLM ID
9716531
PMCID
PMC2818804
Subset
IM
Grants
NIMH NIH HHS · 1R03MH085679-01 · United States
Wellcome Trust · United Kingdom
CIHR · Canada
NCI NIH HHS · T32 CA009172 · United States
Intramural NIH HHS · Z99 HG999999 · United States
NIMH NIH HHS · R03 MH085679 · United States
NIGMS NIH HHS · R01 GM056203 · United States
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